5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide

C14H14BrFN4O — CID 62236094

IUPAC5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cc(Br)cnc1NN)c1ccc(F)cc1
InChIInChI=1S/C14H14BrFN4O/c1-2-20(11-5-3-10(16)4-6-11)14(21)12-7-9(15)8-18-13(12)19-17/h3-8H,2,17H2,1H3,(H,18,19)
InChIKeyNQRVDTYVDREBBX-UHFFFAOYSA-N
MW353.20 g/mol
LogP2.94
Rot. Bonds4

About 5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide

5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide (PubChem CID 62236094) has the molecular formula C14H14BrFN4O and a molecular weight of 353.20 g/mol. Its IUPAC name is 5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide
PubChem CID62236094
Molecular FormulaC14H14BrFN4O
Molecular Weight353.20 g/mol
Exact Mass352.03
IUPAC Name5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cc(Br)cnc1NN)c1ccc(F)cc1
InChIInChI=1S/C14H14BrFN4O/c1-2-20(11-5-3-10(16)4-6-11)14(21)12-7-9(15)8-18-13(12)19-17/h3-8H,2,17H2,1H3,(H,18,19)
InChIKeyNQRVDTYVDREBBX-UHFFFAOYSA-N
XLogP2.94
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.20
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-bromo-N-ethyl-2-hydrazinyl-N-pyridin-4-ylpyridine-3-carboxamide
CID 106937594
2-amino-5-bromo-N-ethyl-N-(4-methylphenyl)pyridine-3-carboxamide
CID 62161411
5-bromo-2-hydrazinyl-N-(1-methoxypropan-2-yl)-N-methylpyridine-3-carboxamide
CID 62236996
2-bromo-N-ethyl-N-(4-fluorophenyl)benzamide
CID 60592661
N-ethyl-3-fluoro-2-hydrazinyl-N-(4-methylphenyl)pyridine-4-carboxamide
CID 105388008
5-bromo-2-chloro-N-ethyl-N-pyridin-4-ylpyridine-3-carboxamide
CID 113236092
5-bromo-2-hydrazinyl-N-(2-methylpropyl)-N-pentan-3-ylpyridine-3-carboxamide
CID 79487064
3-bromo-N-ethyl-4-fluoro-N-(4-fluorophenyl)benzamide
CID 103706641
3-amino-N-ethyl-N-(4-fluorophenyl)pyridine-4-carboxamide
CID 105069018
5-bromo-2-hydrazinyl-N-(5-hydroxypentyl)-N-methylpyridine-3-carboxamide
CID 107204449
5-bromo-N-[(3-fluorophenyl)methyl]-2-hydrazinylpyridine-3-carboxamide
CID 62241265
4-bromo-N-ethyl-N-(4-fluorophenyl)-1H-pyrrole-2-carboxamide
CID 60667423

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide (CID 62236094) is 5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide is CCN(C(=O)c1cc(Br)cnc1NN)c1ccc(F)cc1.
What is the InChIKey of 5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide?
The InChIKey is NQRVDTYVDREBBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrFN4O/c1-2-20(11-5-3-10(16)4-6-11)14(21)12-7-9(15)8-18-13(12)19-17/h3-8H,2,17H2,1H3,(H,18,19).
What are the key properties of 5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide?
5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide has a molecular weight of 353.20 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-ethyl-N-(4-fluorophenyl)-2-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 62236094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).